MSLU8

Prompt

1.13.11.57

Oxidoreductases. Acting on single donors with incorporation of molecular oxygen (oxygenases). The oxygen incorporated need not be derived from O2. With incorporation of two atoms of oxygen. gallate dioxygenase.

AI Generated Sequence

468 AAs
MAGEIIGGLATSHTPTIGFALDQAKQDPVWKPIFEGYQPIAEWLAEKKPDVLFIIYNDHVTSFFFDHYSAFTLGVGDTYQADEDGGGRRPLPPVKGHPELARHIASSLMADEFDMTFFQDMPLDHGCFVPLSMLCPKGGWPVKVIPLQVGVLQFPVPSARRCYKLGQALRRAIESYPEDLNVAVIATGGLSHQVHGERTGFNNPEWDARFLDLLERDPEKFAAMTPQEYAELGGGEGAEIIMWLVMRGALSAKVTRLHRSYYLPSMTGIATLILENENAELPEALNAAERARHAQQLAEIEEQVGTYPSLETAGRKAYRLNTMLHRMEGPAYRRAFFAQEHAAFVAAGFDAAERALIRRDDWRGLHMYGVAFFLLEKLGTAVGVSNLQVYAAWRGELTFAAFTEEVRRTHGAALGGGGAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA

Ligand/Cofactor

NAD(+)

C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N

Validation Metrics

PLDDT72.7
NLMSIM75.0
AACOMP86.7
Seqdif (SeqID)32.3 (WP_309817644.1)
Structdif (F-Target)10.3 (1bou D)

ProtNLM

NameScore
Gallate dioxygenase0.464
1.13.11.80.161
Protocatechuate 3,4-dioxygenase0.089
Protocatechuate 4,5-dioxygenase alpha subunit /protocatechuate 4,5-dioxygenase beta subunit0.037
LigB domain-containing protein0.028
Protocatechuate 4,5-dioxygenase beta chain0.021
Designed by MP, using an AMD MI250 GPU